(3E)-3-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-5-(4-ethoxyphenyl)furan-2-one

Systemtic Name: (3E)-3-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-5-(4-ethoxyphenyl)furan-2-one Openeye Name: (3E)-3-[(3-bromo-4,5-dimethoxy-phenyl)methylene]-5-(4-ethoxyphenyl)furan-2-one CAS Name: (3E)-3-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-5-(4-ethoxyphenyl)-2-furanone IUPAC Name: (3E)-3-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-5-(4-ethoxyphenyl)furan-2-one Traditional Name: (3E)-3-(3-bromo-4,5-dimethoxy-benzylidene)-5-p-phenetyl-furan-2-one Formula: C21H19BrO5 MolecularWeight: 431.27656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=CC3=CC(=C(C(=C3)Br)OC)OC)C(=O)O2

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C/C(=C\C3=CC(=C(C(=C3)Br)OC)OC)/C(=O)O2

InChI

InChI=1S/C21H19BrO5/c1-4-26-16-7-5-14(6-8-16)18-12-15(21(23)27-18)9-13-10-17(22)20(25-3)19(11-13)24-2/h5-12H,4H2,1-3H3/b15-9+